Acetic Acid → HCID 15676108, compound
Reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:5][NH:6][c:7]1[n:8][o:9][c:10]([CH:12]([CH3:13])[c:14]2[cH:15][c:16]([C:20]3([c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[O:21][CH2:24][CH2:23][O:22]3)[cH:17][cH:18][cH:19]2)[n:11]1.[OH2:31]>>[CH3:5][NH:6][c:7]1[n:8][o:9][c:10]([CH:12]([CH3:13])[c:14]2[cH:15][c:16]([C:20](=[O:21])[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:17][cH:18][cH:19]2)[n:11]1Participants
4
Sources & evidence
- ORD record
- ord-47ff2ac97be14758a69a4e697eaf4d5e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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